Cd3SnPb2
Alexandria ALEXAlex-ID: agm020512918 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_2550_spg2
Cd Sn Pb
2025-04-13 14:26:56
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm020512918).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
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# CIF generated by HEAS from Alexandria entry agm020512918
data_agm020512918
_cell_length_a 9.43115
_cell_length_b 9.43115
_cell_length_c 6.43765
_cell_angle_alpha 77.34406
_cell_angle_beta 102.65594
_cell_angle_gamma 44.74685
_cell_volume 329.62961
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Cd1 Cd 0.11994 0.71249 0.99181 1.00000
Cd2 Cd 0.28751 0.88006 0.99181 1.00000
Cd3 Cd 0.88006 0.28751 0.00819 1.00000
Cd4 Cd 0.71249 0.11994 0.00819 1.00000
Cd5 Cd 0.83542 0.83542 0.50000 1.00000
Cd6 Cd 0.16458 0.16458 0.50000 1.00000
Sn1 Sn 0.33649 0.33649 0.50000 1.00000
Sn2 Sn 0.66351 0.66351 0.50000 1.00000
Pb1 Pb 0.74013 0.74013 0.00000 1.00000
Pb2 Pb 0.70976 0.29024 0.40707 1.00000
Pb3 Pb 0.25987 0.25987 0.00000 1.00000
Pb4 Pb 0.29024 0.70976 0.59293 1.00000
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